SCHEMBL7984974

SCHEMBL7984974

CCS(=O)(=O)NC(=O)c1cccc(Br)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.59
FLT1 P17948 1/20 0.58
FLT4 P35916 1/20 0.58
KDR P35968 1/20 0.58
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
CYP1A2 P05177 2/20 0.54
CYP2C19 P33261 2/20 0.54
SMN1; SMN2 Q16637 5/20 0.51
ALDH1A1 P00352 2/20 0.51
KDM4E B2RXH2 1/20 0.51
POLB P06746 1/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
TP53BP1 Q12888 1/20 0.50
OGG1 O15527 1/20 0.49
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7989112 0.89 L3MBTL1 (0.59) L3MBTL1FLT1FLT4KDRMEN1
SCHEMBL3348416 0.85 FLT1 (0.60) L3MBTL1FLT1FLT4KDRMEN1
SCHEMBL7984819 0.83 HDAC8 (0.64) MEN1KMT2ASMN1; SMN2ALDH1A1POLB
SCHEMBL7983790 0.82 HDAC1 (0.62) L3MBTL1MEN1KMT2ACYP1A2CYP2C19
SCHEMBL7983817 0.82 FLT1 (0.61) FLT1FLT4KDRMEN1KMT2A
SCHEMBL29659751 0.82 HDAC1 (0.62) L3MBTL1MEN1KMT2ACYP1A2CYP2C19
SCHEMBL9302340 0.82 KDM4E (0.57) MEN1KMT2ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL7990884 0.81 OGG1 (0.55) L3MBTL1MEN1KMT2ACYP1A2SMN1; SMN2
SCHEMBL1370670 0.80 LMNA (0.54) L3MBTL1FLT1FLT4KDRMEN1
SCHEMBL17336774 0.80 KDM4E (0.64) L3MBTL1FLT1FLT4KDRMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6331628-B1 REACTING A SUBSTITUTED HALOBENZENE WITH POTASSIUM, SODIUM AND/OR ZINC CYANIDE IN THE PRESENCE OF A METALLIC CATALYST NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2001-12-18 US disclosed